| Reaction Details |
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 | Report a problem with these data |
| Target | Aromatase |
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| Ligand | BDBM50398448 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_872732 (CHEMBL2185145) |
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| IC50 | 20±n/a nM |
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| Citation |  Ghosh, D; Lo, J; Morton, D; Valette, D; Xi, J; Griswold, J; Hubbell, S; Egbuta, C; Jiang, W; An, J; Davies, HM Novel aromatase inhibitors by structure-guided design. J Med Chem55:8464-76 (2012) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Aromatase |
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| Name: | Aromatase |
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| Synonyms: | ARO1 | Aromatase | CP19A_HUMAN | CYAR | CYP19 | CYP19A1 | CYPXIX | Cytochrome P-450AROM | Cytochrome P450 19A1 | Cytochrome P450 2C19 | Cytochrome P450-C19 (CYP19) | Estrogen synthetase | FL cytokine receptor precursor | P-450AROM |
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| Type: | Enzyme |
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| Mol. Mass.: | 57888.92 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P11511 |
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| Residue: | 503 |
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| Sequence: | MVLEMLNPIHYNITSIVPEAMPAATMPVLLLTGLFLLVWNYEGTSSIPGPGYCMGIGPLI
SHGRFLWMGIGSACNYYNRVYGEFMRVWISGEETLIISKSSSMFHIMKHNHYSSRFGSKL
GLQCIGMHEKGIIFNNNPELWKTTRPFFMKALSGPGLVRMVTVCAESLKTHLDRLEEVTN
ESGYVDVLTLLRRVMLDTSNTLFLRIPLDESAIVVKIQGYFDAWQALLIKPDIFFKISWL
YKKYEKSVKDLKDAIEVLIAEKRRRISTEEKLEECMDFATELILAEKRGDLTRENVNQCI
LEMLIAAPDTMSVSLFFMLFLIAKHPNVEEAIIKEIQTVIGERDIKIDDIQKLKVMENFI
YESMRYQPVVDLVMRKALEDDVIDGYPVKKGTNIILNIGRMHRLEFFPKPNEFTLENFAK
NVPYRYFQPFGFGPRGCAGKYIAMVMMKAILVTLLRRFHVKTLQGQCVESIQKIHDLSLH
PDETKNMLEMIFTPRNSDRCLEH
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| BDBM50398448 |
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| n/a |
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| Name | BDBM50398448 |
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| Synonyms: | CHEMBL2179114 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H28O4 |
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| Mol. Mass. | 368.466 |
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| SMILES | C[C@]12CC[C@H]3[C@@H](C[C@@H](OCC#CCO)C4=CC(=O)C=C[C@]34C)[C@@H]1CCC2=O |r,c:18,t:14| |
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| Structure | 
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